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branch 5.1.1

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Dunyou Wang 2008-08-18 16:11:05 +00:00
parent d490a00c30
commit b321f3ab14
7 changed files with 20 additions and 20 deletions
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2
doc/prog/instaport.tex
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@ -13,7 +13,7 @@ variables, libraries, and makefiles needed to run the code.
\section{How to Obtain NWChem}
The NWChem source code tree current release is version 4.5. To obtain NWChem
The NWChem source code tree current release is version 5.1.1. To obtain NWChem
a User's Agreement must be properly filled out and sent to us. The User's
Agreement may be found on the NWChem webpages at

6
doc/prog/prog.tex
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@ -1,11 +1,11 @@
% $Id: prog.tex,v 1.14 2003-02-20 23:13:52 windus Exp $
% $Id: prog.tex,v 1.15 2008-08-18 16:10:34 d3p307 Exp $
\documentstyle[fullpage,12pt,fleqn]{book}
\setlength{\parskip}{6pt}
\newcommand{\TRUE}{\verb+.true.+}
\newcommand{\FALSE}{\verb+.false.+}
\newcommand{\nwchemversion}{4.5}
\newcommand{\nwchemyear}{2003}
\newcommand{\nwchemversion}{5.1.1}
\newcommand{\nwchemyear}{2008}
\begin{document}

6
doc/user/main.tex
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@ -1,10 +1,10 @@
% $Id: main.tex,v 1.26 2008-08-15 15:43:41 bylaska Exp $
% $Id: main.tex,v 1.27 2008-08-18 16:09:49 d3p307 Exp $
\setlength{\parskip}{6pt}
% Set the version and year of release globally
\newcommand{\nwchemversion}{5.1}
\newcommand{\nwchemyear}{2007}
\newcommand{\nwchemversion}{5.1.1}
\newcommand{\nwchemyear}{2008}
\newcommand{\nwchemmonth}{September}
\newcommand{\angstroms}{Angstr{\o}ms}

4
src/COPYRIGHT.fh
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@ -1,6 +1,6 @@
*---------------------------------------------------------------------*
* COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, *
* 2000, 2001, 2002, 2003, 2004, 2005, 2006, 2007 *
* COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, 2000 *
* 2001, 2002, 2003, 2004, 2005, 2006, 2007, 2008 *
* Pacific Northwest National Laboratory, *
* Battelle Memorial Institute. *
*---------------------------------------------------------------------*

4
src/COPYRIGHT.h
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@ -1,7 +1,7 @@
/**\
-------------------------------------------------------------------
COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999,
2000, 2001, 2002, 200, 2004, 2005, 2006, 2007
COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, 2000
2001, 2002, 200, 2004, 2005, 2006, 2007, 2008
Pacific Northwest National Laboratory,
Battelle Memorial Institute.
-------------------------------------------------------------------

8
src/nwchem.F
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@ -23,10 +23,10 @@
integer junk(4)
#endif
c
c $Id: nwchem.F,v 1.161 2007-10-16 23:43:08 d3p307 Exp $
c $Id: nwchem.F,v 1.162 2008-08-18 16:06:53 d3p307 Exp $
*---------------------------------------------------------------------*
* COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, *
* 2000, 2001, 2002, 2003, 2004, 2005, 2006, 2007 *
* COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, 2000 *
* 2001, 2002, 2003, 2004, 2005, 2006, 2007,2008 *
* Pacific Northwest National Laboratory, *
* Battelle Memorial Institute. *
*---------------------------------------------------------------------*
@ -466,7 +466,7 @@ C
C Print version information to ecce.out file
C
compiled(inp_strlen(compiled)+1:inp_strlen(compiled)+25) =
$ ' Version 4.5'
$ ' Version 5.1.1'
call ecce_print_version(compiled(1:inp_strlen(compiled)))
C
If ( Inp_StrLen(BatchID) .gt. 0) then

10
src/util/util_legal.F
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@ -1,8 +1,8 @@
subroutine util_legal()
* $Id: util_legal.F,v 1.49 2008-07-24 18:47:48 bert Exp $
* $Id: util_legal.F,v 1.50 2008-08-18 16:05:53 d3p307 Exp $
*--------------------------------------------------------------------*
* COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, *
* 2000, 2001, 2002, 2003, 2004, 2005, 2006, 2007 *
* COPYRIGHT (C) 1994, 1995, 1996, 1997, 1998, 1999, 2000 *
* 2001, 2002, 2003, 2004, 2005, 2006, 2007, 2008 *
* Pacific Northwest National Laboratory, *
* Battelle Memorial Institute. *
*--------------------------------------------------------------------*
@ -161,7 +161,7 @@ c
& /,12x,
& 'Computational Chemistry Package for Parallel Computers, ',
& /,12x,
& 'Version 5.1" (2007), ',
& 'Version 5.1.1" (2008), ',
& 'Pacific Northwest National Laboratory,',
& /,12x,
& 'Richland, Washington 99352-0999, USA.'
@ -200,7 +200,7 @@ c
+ 10x,'"NWChem, A Computational Chemistry Package for Parallel ',
& 'Computers, ',
& /,10x,
& 'Version 5.1" (2007),',
& 'Version 5.1.1" (2008),',
& /,22x,'Pacific Northwest National Laboratory,',
& /,22x,'Richland, Washington 99352-0999, USA.'
& /,/)